5,6-bis(chloranyl)-2-(1-pyrrolidin-1-ylethyl)-1,2-benzothiazol-3-one hydrochloride

Systemtic Name: 5,6-bis(chloranyl)-2-(1-pyrrolidin-1-ylethyl)-1,2-benzothiazol-3-one hydrochloride Openeye Name: 5,6-dichloro-2-(1-pyrrolidin-1-ylethyl)-1,2-benzothiazol-3-one hydrochloride CAS Name: 5,6-dichloro-2-[1-(1-pyrrolidinyl)ethyl]-1,2-benzothiazol-3-one hydrochloride IUPAC Name: 5,6-dichloro-2-(1-pyrrolidin-1-ylethyl)-1,2-benzothiazol-3-one hydrochloride Traditional Name: 5,6-dichloro-2-(1-pyrrolidinoethyl)-1,2-benzothiazol-3-one hydrochloride Formula: C13H15Cl3N2OS MolecularWeight: 353.695

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Descriptors Computed from Structure

Canonical SMILES:

CC(N1CCCC1)N2C(=O)C3=CC(=C(C=C3S2)Cl)Cl.Cl

Isomeric SMILES

CC(N1CCCC1)N2C(=O)C3=CC(=C(C=C3S2)Cl)Cl.Cl

InChI

InChI=1S/C13H14Cl2N2OS.ClH/c1-8(16-4-2-3-5-16)17-13(18)9-6-10(14)11(15)7-12(9)19-17;/h6-8H,2-5H2,1H3;1H